Vitas-M small molecule compound

methyl [(5-cyclopropyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate

Catalog ID
STK470136
SMILES COC(=O)CSc1nnc(n1C)C1CC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C9H13N3O2S MW 227.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H13N3O2S/c1-12-8(6-3-4-6)10-11-9(12)15-5-7(13)14-2/h6H,3-5H2,1-2H3
InChIKey
CGOMKAPZFNFKSG-UHFFFAOYSA-N
Synonyms

CN1C(=NN=C1SCC(=O)OC)C2CC2
InChI=1SC9H13N3O2Sc1128(6346)10119(12)1557(13)142h6H35H212H3
methyl((5cyclopropyl4methyl4H124triazol3yl)sulfanyl)acetate
METHYL2((5CYCLOPROPYL4METHYL124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(5CYCLOPROPYL4METHYL124TRIAZOL3YLTHIO)ACETATE
MFCD06034762
ZINC000006726129
ZINC06726129
ZINC6726129

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.